N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-tosyl-propionamide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=CC=CC=C3S2)C

InChI

InChI=1S/C18H18N2O3S2/c1-13-7-9-14(10-8-13)25(22,23)12-11-17(21)19-18-20(2)15-5-3-4-6-16(15)24-18/h3-10H,11-12H2,1-2H3